2-[2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]-N-propyl-benzamide

Systemtic Name: 2-[2-[(3-fluorophenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]ethanoylamino]-N-propyl-benzamide Openeye Name: 2-[[2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonyl-anilino)acetyl]amino]-N-propyl-benzamide CAS Name: 2-[[2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonylanilino)-1-oxoethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[2-(3-fluoro-N-(4-methylsulfanylphenyl)sulfonylanilino)acetyl]amino]-N-propylbenzamide Traditional Name: 2-[[2-(3-fluoro-N-[4-(methylthio)phenyl]sulfonyl-anilino)acetyl]amino]-N-propyl-benzamide Formula: C25H26FN3O4S2 MolecularWeight: 515.620043

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=CC=C2)F)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C25H26FN3O4S2/c1-3-15-27-25(31)22-9-4-5-10-23(22)28-24(30)17-29(19-8-6-7-18(26)16-19)35(32,33)21-13-11-20(34-2)12-14-21/h4-14,16H,3,15,17H2,1-2H3,(H,27,31)(H,28,30)